[2-(3-methylhex-1-en-2-yl)phenyl]methanol

C14H20O — CID 142108437

IUPAC[2-(3-methylhex-1-en-2-yl)phenyl]methanol
SMILESC=C(c1ccccc1CO)C(C)CCC
InChIInChI=1S/C14H20O/c1-4-7-11(2)12(3)14-9-6-5-8-13(14)10-15/h5-6,8-9,11,15H,3-4,7,10H2,1-2H3
InChIKeyXYBGSGQAWAGXMB-UHFFFAOYSA-N
MW204.31 g/mol
LogP3.63
Rot. Bonds5

About [2-(3-methylhex-1-en-2-yl)phenyl]methanol

[2-(3-methylhex-1-en-2-yl)phenyl]methanol (PubChem CID 142108437) has the molecular formula C14H20O and a molecular weight of 204.31 g/mol. Its IUPAC name is [2-(3-methylhex-1-en-2-yl)phenyl]methanol.

Molecular Properties

Compound Name[2-(3-methylhex-1-en-2-yl)phenyl]methanol
PubChem CID142108437
Molecular FormulaC14H20O
Molecular Weight204.31 g/mol
Exact Mass204.15
IUPAC Name[2-(3-methylhex-1-en-2-yl)phenyl]methanol
SMILESC=C(c1ccccc1CO)C(C)CCC
InChIInChI=1S/C14H20O/c1-4-7-11(2)12(3)14-9-6-5-8-13(14)10-15/h5-6,8-9,11,15H,3-4,7,10H2,1-2H3
InChIKeyXYBGSGQAWAGXMB-UHFFFAOYSA-N
XLogP3.63
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.31
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[[2-(3-methylhex-1-en-2-yl)phenyl]methyl]prop-2-en-1-amine
CID 142108454
N-(2-acetylphenyl)-2-methylpentanamide
CID 43183491
N-(3-hydroxybutan-2-yl)-2-(hydroxymethyl)benzamide
CID 23521831
methyl 2-(2-methylpentanoylamino)benzoate
CID 2904418
N-[2-(bromomethyl)phenyl]-2-methylpentanamide
CID 114309617
1-(2-bromophenyl)-2-methylpentan-1-one
CID 107891390
2-methyl-N-naphthalen-1-ylpentanamide
CID 112762783
N-[(1R)-2-hydroxy-1-phenylethyl]-2-methylpentanamide
CID 113258887
2-(hydroxymethyl)-N-tetradecylbenzamide
CID 23299401
1-(2-ethylphenyl)-2-propylpentan-1-one
CID 146006581
[2-(2-methylbutyl)phenyl]methanol
CID 66698085
1-(2-propylphenyl)ethenol
CID 89240118

Frequently Asked Questions

What is the IUPAC name of [2-(3-methylhex-1-en-2-yl)phenyl]methanol?
The IUPAC name of [2-(3-methylhex-1-en-2-yl)phenyl]methanol (CID 142108437) is [2-(3-methylhex-1-en-2-yl)phenyl]methanol.
What is the SMILES notation for [2-(3-methylhex-1-en-2-yl)phenyl]methanol?
The canonical SMILES for [2-(3-methylhex-1-en-2-yl)phenyl]methanol is C=C(c1ccccc1CO)C(C)CCC.
What is the InChIKey of [2-(3-methylhex-1-en-2-yl)phenyl]methanol?
The InChIKey is XYBGSGQAWAGXMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O/c1-4-7-11(2)12(3)14-9-6-5-8-13(14)10-15/h5-6,8-9,11,15H,3-4,7,10H2,1-2H3.
What are the key properties of [2-(3-methylhex-1-en-2-yl)phenyl]methanol?
[2-(3-methylhex-1-en-2-yl)phenyl]methanol has a molecular weight of 204.31 g/mol, XLogP of 3.63, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-methylhex-1-en-2-yl)phenyl]methanol is sourced from PubChem (CID 142108437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).